CFam Chemical Families Database
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You are searching for "CFAMM00452593" in compound.

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CFAM Mol ID CFAMM00452593
Family CFFBM19659 Squalene monooxygenase inhibitor 2-[[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethylamino]methyl]phenoxy]methyl-dimethylsilyl]benzonitrile family
Superfamily CFSBM7640 Squalene monooxygenase Binder Superfamily
Class CFCCD153 Class 966
External ID CHEMBL107546 External Source CHEMBL
PubChem CID 9803536 Functional Category Bioactive
Molecule Name 2-[[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethylamino]methyl]phenoxy]methyl-dimethylsilyl]benzonitrile
IUPAC Name 2-[[3-[[[(E)-6,6-dimethylhept-2-en-4-ynyl]-ethylamino]methyl]phenoxy]methyl-dimethylsilyl]benzonitrile
Synonyms CHEBI:278910
InChi InChI=1S/C28H36N2OSi/c1-7-30(19-12-8-11-18-28(2,3)4)22-24-14-13-16-26(20-24)31-23-32(5,6)27-17-10-9-15-25(27)21-29/h8-10,12-17,20H,7,19,22-23H2,1-6H3/b12-8+
InChiKey SADUBVXUWQTVGN-XYOKQWHBSA-N
Formula C28H36N2OSi Molecular Weight 444.68
Cross Link CHEMBL107546
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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